1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone

C11H12ClNOS — CID 7289124

IUPAC1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone
SMILESCC(=O)N1CCS[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C11H12ClNOS/c1-8(14)13-5-6-15-11(13)9-3-2-4-10(12)7-9/h2-4,7,11H,5-6H2,1H3/t11-/m1/s1
InChIKeyMWKJONOSLFXIDV-LLVKDONJSA-N
MW241.74 g/mol
LogP2.93
Rot. Bonds1

About 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone

1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone (PubChem CID 7289124) has the molecular formula C11H12ClNOS and a molecular weight of 241.74 g/mol. Its IUPAC name is 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone.

Molecular Properties

Compound Name1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone
PubChem CID7289124
Molecular FormulaC11H12ClNOS
Molecular Weight241.74 g/mol
Exact Mass241.03
IUPAC Name1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone
SMILESCC(=O)N1CCS[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C11H12ClNOS/c1-8(14)13-5-6-15-11(13)9-3-2-4-10(12)7-9/h2-4,7,11H,5-6H2,1H3/t11-/m1/s1
InChIKeyMWKJONOSLFXIDV-LLVKDONJSA-N
XLogP2.93
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.74
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone with MolForge

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Related Compounds

2-chloro-1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone
CID 7326995
[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(2-methylphenyl)methanone
CID 4062642
[(2S)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(2-methylphenyl)methanone
CID 7360453
[(2S)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(2,4-dichlorophenyl)methanone
CID 7438620
(2S)-2-(3-chlorophenyl)-N-phenyl-1,3-thiazolidine-3-carboxamide
CID 7409403
[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-pyrazin-2-ylmethanone
CID 122331182
(2R)-2-(3-chlorophenyl)-N-(2,6-dichlorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7226698
[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(4-iodophenyl)methanone
CID 122331337
1-[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-2-phenylethanone
CID 42781088
[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(4-methylsulfanylphenyl)methanone
CID 122331258
(2S)-2-(3-chlorophenyl)-N-cyclohexyl-1,3-thiazolidine-3-carboxamide
CID 7414110
2-(3-chlorophenyl)-N-cyclohexyl-1,3-thiazolidine-3-carboxamide
CID 4142914

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone?
The IUPAC name of 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone (CID 7289124) is 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone.
What is the SMILES notation for 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone?
The canonical SMILES for 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone is CC(=O)N1CCS[C@@H]1c1cccc(Cl)c1.
What is the InChIKey of 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone?
The InChIKey is MWKJONOSLFXIDV-LLVKDONJSA-N. The full InChI is InChI=1S/C11H12ClNOS/c1-8(14)13-5-6-15-11(13)9-3-2-4-10(12)7-9/h2-4,7,11H,5-6H2,1H3/t11-/m1/s1.
What are the key properties of 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone?
1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone has a molecular weight of 241.74 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]ethanone is sourced from PubChem (CID 7289124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).